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CAS No.: | 23012-14-8 |
---|---|
Name: | Ethyl oxazole-4-carboxylate |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H7NO3 |
Molecular Weight: | 141.126 |
Synonyms: | Ethyl oxazole-4-carboxylate;Ethyl1,3-oxazole-4-carboxylate; |
Density: | 1.177 g/cm3 |
Melting Point: | 48 °C |
Boiling Point: | 202 °C at 760 mmHg |
Flash Point: | 75.9 °C |
Hazard Symbols: | Xi |
Safety: | 24/25 |
PSA: | 52.33000 |
LogP: | 0.85130 |
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The Ethyl Oxazole-4-Carboxylate, with the CAS registry number 23012-14-8, is also known as Oxazole-4-carboxylic acid ethyl ester. It belongs to the product categories of Carboxylicester; Blocks; Oxazoles; Building Blocks; Oxazole. This chemical's molecular formula is C6H7NO3 and molecular weight is 141.12468. Its IUPAC name is called ethyl 1,3-oxazole-4-carboxylate. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes. You must avoid contacting it with skin and eyes.
Physical properties of Ethyl Oxazole-4-Carboxylate: (1)ACD/LogP: 0.63; (2)ACD/LogD (pH 5.5): 0.63; (3)ACD/LogD (pH 7.4): 0.63; (4)ACD/BCF (pH 5.5): 1.77; (5)ACD/BCF (pH 7.4): 1.77; (6)ACD/KOC (pH 5.5): 52.38; (7)ACD/KOC (pH 7.4): 52.38; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.463; (11)Molar Refractivity: 33.04 cm3; (12)Molar Volume: 119.8 cm3; (13)Surface Tension: 39.2 dyne/cm; (14)Density: 1.177 g/cm3; (15)Flash Point: 75.9 °C; (16)Enthalpy of Vaporization: 43.82 kJ/mol; (17)Boiling Point: 202 °C at 760 mmHg; (18)Vapour Pressure: 0.3 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)C1=COC=N1
(2)InChI: InChI=1S/C6H7NO3/c1-2-10-6(8)5-3-9-4-7-5/h3-4H,2H2,1H3
(3)InChIKey: UBESIXFCSFYQNK-UHFFFAOYSA-N